 Home > Encyclopedia > (6aS,7aS,8aR,8bR)-2,3,6a,7a,8a,8b-Hexahydro-4-methoxycyclopent[c]oxireno[4′,5′]furo[3′,2′:4,5]furo[2,3-h][1]benzopyran-1,10-dione

(6aS,7aS,8aR,8bR)-2,3,6a,7a,8a,8b-Hexahydro-4-methoxycyclopent[c]oxireno[4′,5′]furo[3′,2′:4,5]furo[2,3-h][1]benzopyran-1,10-dione

(6aS,7aS,8aR,8bR)-2,3,6a,7a,8a,8b-Hexahydro-4-methoxycyclopent[c]oxireno[4′,5′]furo[3′,2′:4,5]furo[2,3-h][1]benzopyran-1,10-dione structure

CAS No:
42583-46-0
Formula:
C17H12O7
Chemical Name:
(6aS,7aS,8aR,8bR)-2,3,6a,7a,8a,8b-Hexahydro-4-methoxycyclopent[c]oxireno[4′,5′]furo[3′,2′:4,5]furo[2,3-h][1]benzopyran-1,10-dione
Synonyms:
Cyclopent[c]oxireno[4′,5′]furo[3′,2′:4,5]furo[2,3-h][1]benzopyran-1,10-dione,2,3,6a,7a,8a,8b-hexahydro-4-methoxy-,(6aS,7aS,8aR,8bR)-;Cyclopent[c]oxireno[4′,5′]furo[3′,2′:4,5]furo[2,3-h][1]benzopyran-1,10-dione,2,3,6a,7a,8a,8b-hexahydro-4-methoxy-,[6aS-(6aα,7aβ,8aβ,8bα)]-;(6aS,7aS,8aR,8bR)-2,3,6a,7a,8a,8b-Hexahydro-4-methoxycyclopent[c]oxireno[4′,5′]furo[3′,2′:4,5]furo[2,3-h][1]benzopyran-1,10-dione;Aflatoxin B1 2,3-epoxide;2,3-Epoxyaflatoxin B1;Aflatoxin B1,2,3-oxide;Aflatoxin B1 8,9-oxide;Aflatoxin B1 8,9-epoxide;Aflatoxin B1 exo-8,9-epoxide;exo-Aflatoxin B1-8,9-epoxide;AFB1 8,9-oxide;117859-29-7;67337-06-8;90358-59-1

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Description

Solid

Aflatoxin B1 exo-8,9-epoxide is an aflatoxin. It has a role as a human metabolite.

(6aS,7aS,8aR,8bR)-2,3,6a,7a,8a,8b-Hexahydro-4-methoxycyclopent[c]oxireno[4′,5′]furo[3′,2′:4,5]furo[2,3-h][1]benzopyran-1,10-dione Basic Attributes

Molecular Weight：

328.275

Exact Mass：

328.27

Characteristics

PSA：

83.6

XLogP3：

1.48770

Appearance：

Solid

Density：

1.68g/cm3

Boiling Point：

549.9ºC at 760mmHg

Flash Point：

247.5ºC

Safety Information

Packing level：

Hazard category：

6.1(a)

Transport codes：

3172

Drug Information

MeSH：

Substances that increase the risk of NEOPLASMS in humans or animals. Both genotoxic chemicals, which affect DNA directly, and nongenotoxic chemicals, which induce neoplasms by other mechanism, are included. (See all compounds classified as Carcinogens.)

MeSH Entry Terms：

AFB epoxide

Computed Properties

Molecular Weight:328.27
XLogP3:0.8
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:1
Exact Mass:328.05830272
Monoisotopic Mass:328.05830272
Topological Polar Surface Area:83.6
Heavy Atom Count:24
Complexity:684
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: campylobacter enteritis; tert butyl alcohol; uranium oxide; silver sulfate; cholinoid; aluminum carbonate formula

Guide of (6aS,7aS,8aR,8bR)-2,3,6a,7a,8a,8b-Hexahydro-4-methoxycyclopent[c]oxireno[4′,5′]furo[3′,2′:4,5]furo[2,3-h][1]benzopyran-1,10-dione

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

(6aS,7aS,8aR,8bR)-2,3,6a,7a,8a,8b-Hexahydro-4-methoxycyclopent[c]oxireno[4′,5′]furo[3′,2′:4,5]furo[2,3-h][1]benzopyran-1,10-dione

SDS

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