BGC > Product Search > Lithospermic acid | 28831-65-4

Molecular Formula: C27H22O12
Molecular Weight: 538.459

Molecular Formula: C27H22O12
Molecular Weight: 538.459

Description :
Lithospermic acid is extracted from the roots of Lithospermum ruderale. It is Cardiotonic agent. It possesses anti-HIV activity.

• Molecular Weight :538.5
• Purity :> 98%

Molecular Formula :
C27H22O12
Canonical SMILES :
C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)O)O)O
InChI :
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
InChIKey :
UJZQBMQZMKFSRV-RGKBJLTCSA-N
Appearance :
Powder
Synonyms :
4-{(E)-2-[1-Carboxy-2-(3,4-dihydroxy-phenyl)-ethoxycarbonyl]-vinyl}-2-(3,4-dihydroxy-phenyl)-7-hydroxy-2,3-dihydro-benzofuran-3-carboxylic acid; Aids071478; Aids-071478; Clinopodic acid H

More details are to be found here

Description :
Lithospermic acid is extracted from the roots of Lithospermum ruderale. It is Cardiotonic agent. It possesses anti-HIV activity.

• Molecular Weight :538.5
• Purity :> 98%

Molecular Formula :
C27H22O12
Canonical SMILES :
C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)O)O)O
InChI :
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
InChIKey :
UJZQBMQZMKFSRV-RGKBJLTCSA-N
Appearance :
Powder
Synonyms :
4-{(E)-2-[1-Carboxy-2-(3,4-dihydroxy-phenyl)-ethoxycarbonyl]-vinyl}-2-(3,4-dihydroxy-phenyl)-7-hydroxy-2,3-dihydro-benzofuran-3-carboxylic acid; Aids071478; Aids-071478; Clinopodic acid H

More details are to be found here