SALVIANOLIC ACID B

CAS No.
4773-96-0 ;115939-25-8 ;121521-90-2
CCD No.
CCD00606932
Formula
C36 H30 O16
MolWeight
718.617

Basic Information

Product Name: SALVIANOLIC ACID B
CAS: 4773-96-0 ;115939-25-8 ;121521-90-2
English Synonyms: DAN SHEN SUAN B ; (R)-2-(((2R,3R)-4-((E)-3-((R)-1-CARBOXY-2-(3,4-DIHYDROXYPHENYL)ETHOXY)-3-OXOPROP-1-EN-1-YL)-2-(3,4-DIHYDROXYPHENYL)-7-HYDROXY-2,3-DIHYDROBENZOFURAN-3-CARBONYL)OXY)-3-(3,4-DIHYDROXYPHENYL)PROPANOIC ACID ; (2S,3S)-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-3-BENZOFURANCARBOXYLIC ACID 3-[(1R)-1-CARBOXY-2-(3,4-DIHYDROXYPHENYL)ETHYL] ESTER ; DANFENSUAN B ; SALVIANIC ACID B ; LITHOSPERMIC ACID B ; (2R)-2-([(2E)-3-[(2R,3R)-3-[[1-CARBOXY-2-(3,4-DIHYDROXYPHENYL)ETHOXY]CARBONYL]-2-(3,4-DIHYDROXYPHENYL)-7-HYDROXY-2,3-DIHYDRO-1-BENZO ; (2S*,3S*)-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-3-BENZOFURANCARBOXYLIC ACID 3-[(1R)-1-CARBOXY-2-(3,4-DIHYDROXYPHENYL)ETHYL] ESTER ; SALVIANOLIC ACID B
MDL Number.: MFCD07779133
H bond acceptor: 16
H bond donor: 9
Smile: c1cc(c(cc1C[C@H](C(=O)O)OC(=O)/C=C/c2ccc(c3c2[C@H]([C@@H](O3)c4ccc(c(c4)O)O)C(=O)O[C@H](Cc5ccc(c(c5)O)O)C(=O)O)O)O)O
InChi: InChI=1S/C36H30O16/c37-20-6-1-16(11-24(20)41)13-27(34(45)46)50-29(44)10-5-18-3-9-23(40)33-30(18)31(32(52-33)19-4-8-22(39)26(43)15-19)36(49)51-28(35(47)48)14-17-2-7-21(38)25(42)12-17/h1-12,15,27-28,31-32,37-43H,13-14H2,(H,45,46)(H,47,48)/b10-5+/t27-,28-,31-,32+/m1/s1
InChiKey: InChIKey=SNKFFCBZYFGCQN-PDVBOLEISA-N

Property

Boiling Point: 1020.3°Cat760mmHg
Comments: ASSAY METHOD: HPLC
SHELF LIFE: LIMITED SHELF LIFE, EXPIRY DATE ON THE LABEL
STORAGE TEMPERATURE: 2-8 DEG C
Specification: ANALYTICAL STANDARD

Safety information

Symbol: GHS06 GHS06
Signal word: Danger
Hazard statements: H300
Precautionary statements: P264,P301+P310
hazard symbol: T+
Risk Code: R:28
Safe Code: S:22,28,36/37,45
UN Code: 3462
WGK Germany: 3
Flash point: 322.1°C

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