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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H22O12
Molecular Weight 538.4574
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of LITHOSPERMIC ACID

SMILES

c1cc(c(cc1C[C@]([H])(C(=O)O)OC(=O)/C(/[H])=C(\[H])/c2ccc(c3c2[C@@]([H])([C@@]([H])(c4ccc(c(c4)O)O)O3)C(=O)O)O)O)O

InChI

InChIKey=UJZQBMQZMKFSRV-RGKBJLTCSA-N
InChI=1S/C27H22O12/c28-15-5-1-12(9-18(15)31)10-20(26(34)35)38-21(33)8-4-13-2-7-17(30)25-22(13)23(27(36)37)24(39-25)14-3-6-16(29)19(32)11-14/h1-9,11,20,23-24,28-32H,10H2,(H,34,35)(H,36,37)/b8-4+/t20-,23+,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula C27H22O12
Molecular Weight 538.4574
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
A search for anti-viral properties in Panamanian medicinal plants. The effects on HIV and its essential enzymes.
1999 Jan
Isolation of two highly potent and non-toxic inhibitors of human immunodeficiency virus type 1 (HIV-1) integrase from Salvia miltiorrhiza.
2002 Jul
HIV-1 integrase inhibitory substances from Coleus parvifolius.
2003 Mar
Anti-HIV activities of natural antioxidant caffeic acid derivatives: toward an antiviral supplementation diet.
2005
Three new derivatives of anti-HIV-1 polyphenols isolated from Salvia yunnanensis.
2008 May-Jun
Lithospermic acid as a novel xanthine oxidase inhibitor has anti-inflammatory and hypouricemic effects in rats.
2008 Nov 25
Patents
Substance Class Chemical
Created
by admin
on Sat Jun 26 02:24:58 UTC 2021
Edited
by admin
on Sat Jun 26 02:24:58 UTC 2021
Record UNII
100IP83JAC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LITHOSPERMIC ACID
Common Name English
3-BENZOFURANCARBOXYLIC ACID, 4-((1E)-3-((1R)-1-CARBOXY-2-(3,4-DIHYDROXYPHENYL)ETHOXY)-3-OXO-1-PROPENYL)-2-(3,4-DIHYDROXYPHENYL)-2,3-DIHYDRO-7-HYDROXY-, (2S,3S)-
Common Name English
(+)-LITHOSPERMIC ACID
Common Name English
3-BENZOFURANCARBOXYLIC ACID, 4-(3-(1-CARBOXY-2-(3,4-DIHYDROXYPHENYL)ETHOXY)-3-OXO-1-PROPENYL)-2-(3,4-DIHYDROXYPHENYL)-2,3-DIHYDRO-7-HYDROXY-
Common Name English
3-BENZOFURANCARBOXYLIC ACID, 4-((1E)-3-((1R)-1-CARBOXY-2-(3,4-DIHYDROXYPHENYL)ETHOXY)-3-OXO-1-PROPEN-1-YL)-2-(3,4-DIHYDROXYPHENYL)-2,3-DIHYDRO-7-HYDROXY-, (2S,3S)-
Common Name English
LITHOSPERMIC ACID, (+)-
Common Name English
LITHOSPERMIC ACID A
Common Name English
4-(3-(1-CARBOXY-2-(3,4-DIHYDROXYPHENYL)ETHOXY)-3-OXO-1-PROPENYL)-2-(3,4-DIHYDROXYPHENYL)-2,3-DIHYDRO-7-HYDROXY-3-BENZOFURANCARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
CAS
28831-65-4
Created by admin on Sat Jun 26 02:24:58 UTC 2021 , Edited by admin on Sat Jun 26 02:24:58 UTC 2021
PRIMARY
FDA UNII
100IP83JAC
Created by admin on Sat Jun 26 02:24:58 UTC 2021 , Edited by admin on Sat Jun 26 02:24:58 UTC 2021
PRIMARY
PUBCHEM
6441498
Created by admin on Sat Jun 26 02:24:58 UTC 2021 , Edited by admin on Sat Jun 26 02:24:58 UTC 2021
PRIMARY
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