InChI=1S/C26H36O8/c1-15(11-12-18-17(3)10-7-13-26(18,4)5)8-6-9-16(2)14-19(27)33-25-22(30)20(28)21(29)23(34-25)24(31)32/h6,8-9,11-12,14,20-23,25,28-30H,7,10,13H2,1-5H3,(H,31,32)/b9-6+,12-11+,15-8+,16-14+/t20-,21-,22+,23-,25+/m0/s1

【InChIKey】

InChIKey=MTGFYEHKPMOVNE-NEFMKCFNSA-N

【SMILES】

CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C(=O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)/C)/C

【MOL File】

ALL-TRANS-RETINOYL B….mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:4

H bond acceptor:8

XLogP3:5.0

Bulk/Fine:F

3Material Safety Data Sheet(MSDS)

4CML File

ALL-TRANS-RETINOYL B-GLUCURONIDE.cml

Quick Release

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401-10-5 ALL-TRANS-RETINOYL B-GLUCURONIDE

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】