Helicianeoide B

CAS
496066-89-8
Catalog Number
ACM496066898
Category
Other Products
Molecular Weight
742.63
Molecular Formula
C32H38O20

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Specification

Synonyms
Helicianeoide B
IUPAC Name
3-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
Canonical SMILES
CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)OC5C(C(C(C(O5)COC6C(C(C(CO6)O)O)O)O)O)O)O)O
InChI
InChI=1S/C32H38O20/c1-9-19(38)24(43)29(52-31-26(45)23(42)21(40)17(50-31)8-47-30-25(44)20(39)15(37)7-46-30)32(48-9)51-28-22(41)18-14(36)5-11(33)6-16(18)49-27(28)10-2-3-12(34)13(35)4-10/h2-6,9,15,17,19-21,23-26,29-40,42-45H,7-8H2,1H3/t9-,15+,17+,19-,20-,21+,23-,24+,25+,26+,29+,30-,31-,32-/m0/s1
InChI Key
GBLIGVGNDPHVIN-LOPYEWRSSA-N
Boiling Point
1099.326ºC at 760 mmHg
Flash Point
348.091ºC
Density
1.838g/cm³
Appearance
Yellow powder
Exact Mass
742.19600
H-Bond Acceptor
20
H-Bond Donor
12
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