4-[3-(1,3-Benzodioxol-5-ylmethyl)-2-methylene-3-buten-1-yl]-1,3-benzenediol
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4-[3-(1,3-Benzodioxol-5-ylmethyl)-2-methylene-3-buten-1-yl]-1,3-benzenediol
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CAS No:
158081-97-1
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Formula:
C19H18O4
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Chemical Name:
4-[3-(1,3-Benzodioxol-5-ylmethyl)-2-methylene-3-buten-1-yl]-1,3-benzenediol
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Synonyms:
1,3-Benzenediol,4-[3-(1,3-benzodioxol-5-ylmethyl)-2-methylene-3-buten-1-yl]-;1,3-Benzenediol,4-[3-(1,3-benzodioxol-5-ylmethyl)-2-methylene-3-butenyl]-;4-[3-(1,3-Benzodioxol-5-ylmethyl)-2-methylene-3-buten-1-yl]-1,3-benzenediol;Anolignan A;NSC 665937
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CAS No:
Description
ChEBI: A lignan that consists of buta-1,3-diene substituted by a 2,4-dihydroxybenzyl group at position 2 and a 1,3-benzodioxol-5-ylmethyl group at position 3. It is isolated from the ground stems of Anogeissus acuminata and exhibits anti-HIV activity by inhibiting HIV-1 reverse transcriptase enzyme.
Anolignan A is a lignan that consists of buta-1,3-diene substituted by a 2,4-dihydroxybenzyl group at position 2 and a 1,3-benzodioxol-5-ylmethyl group at position 3. It is isolated from the ground stems of Anogeissus acuminata and exhibits anti-HIV activity by inhibiting HIV-1 reverse transcriptase enzyme. It has a role as a metabolite and a HIV-1 reverse transcriptase inhibitor. It is a lignan, a member of benzodioxoles and a member of resorcinols.
4-[3-(1,3-Benzodioxol-5-ylmethyl)-2-methylene-3-buten-1-yl]-1,3-benzenediol Basic Attributes
310.347
310.34
F7IFG6J8RN
665937
DTXSID60166373
Computed Properties
Molecular Weight:310.3
XLogP3:5.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:310.12050905
Monoisotopic Mass:310.12050905
Topological Polar Surface Area:58.9
Heavy Atom Count:23
Complexity:447
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
4-[3-(1,3-Benzodioxol-5-ylmethyl)-2-methylene-3-buten-1-yl]-1,3-benzenediol
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