Salaspermic acid
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Salaspermic acid
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CAS No:
71247-78-4
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Formula:
C30H48O4
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Chemical Name:
Salaspermic acid
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Synonyms:
2H-3,4a-(Epoxymethano)picene-11-carboxylic acid,eicosahydro-3-hydroxy-4,6b,8a,11,12b,14a-hexamethyl-,(3S,4R,4aR,6aS,6bR,8aS,11R,12aR,12bS,14aR,14bS)-;D:A-Friedooleanan-29-oic acid,3,24-epoxy-3-hydroxy-,(3β,20α)-;(3S,4R,4aR,6aS,6bR,8aS,11R,12aR,12bS,14aR,14bS)-Eicosahydro-3-hydroxy-4,6b,8a,11,12b,14a-hexamethyl-2H-3,4a-(epoxymethano)picene-11-carboxylic acid;2H-3,4a-(Epoxymethano)picene-11-carboxylic acid,eicosahydro-3-hydroxy-4,6b,8a,11,12b,14a-hexamethyl-,[3S-(3α,4α,4aα,6aβ,6bα,8aα,11β,12aα,12bβ,14aα,14bβ)]-;Salaspermic acid;Salaspemic acid
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CAS No:
Description
ChEBI: A hexacyclic triterpenoid that is D:A-friedooleanan-29-oic acid substituted by a hydroxy group at position 3 and an epoxy group across positions 3 and 24 (the (3beta,20alpha stereoisomer). Isolated from Salacia macr sperma and Tripterygium wilfordii, it exhibits anti-HIV activity.
Computed Properties
Molecular Weight:472.7
XLogP3:7.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:472.35526001
Monoisotopic Mass:472.35526001
Topological Polar Surface Area:66.8
Heavy Atom Count:34
Complexity:918
Defined Atom Stereocenter Count:6
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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