InChI=1S/C27H30O15/c28-6-12-17(32)21(36)23(38)26(41-12)15-19(34)14-10(31)5-11(8-1-3-9(30)4-2-8)40-25(14)16(20(15)35)27-24(39)22(37)18(33)13(7-29)42-27/h1-5,12-13,17-18,21-24,26-30,32-39H,6-7H2/t12-,13+,17-,18+,21+,22-,23-,24-,26+,27+/m1/s1

【InChIKey】

InChIKey=FIAAVMJLAGNUKW-QXYWMPPBSA-N

【SMILES】

c1cc(ccc1c2cc(=O)c3c(c(c(c(c3o2)[C@H]4[C@@H]([C@@H]([C@H]([C@@H](O4)CO)O)O)O)O)[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O

【MOL File】

SCHAFTOSIDE.mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:11

H bond acceptor:15

XLogP3:-3.0

Bulk/Fine:F

3Material Safety Data Sheet(MSDS)

4CML File

SCHAFTOSIDE.cml

Quick Release

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51938-32-0 SCHAFTOSIDE

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】