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92090-94-3
KAZUSAMYCIN A
Name
KAZUSAMYCIN A
Formula
C33 H48 O7
MolWeight
556.735
1Identification
【Name】
KAZUSAMYCIN A
【CAS】
【MDL】
MFCD03265635
【English Synonyms】
【Formula】
C33 H48 O7
【MolWeight】
556.735
【Inchi】
InChI=1S/C33H48O7/c1-8-27(13-14-29-24(5)12-15-31(37)40-29)17-21(2)10-9-11-22(3)18-28(20-34)33(39)26(7)32(38)25(6)16-23(4)19-30(35)36/h9,11-15,17-19,21,24-26,28-29,32,34,38H,8,10,16,20H2,1-7H3,(H,35,36)/b11-9+,14-13+,22-18+,23-19+,27-17+
【InChIKey】
InChIKey=KZMHNEBMQDBQND-MRBODPGGSA-N
【SMILES】
CC/C(=C\C(C)C/C=C/C(=C/C(CO)C(=O)C(C)C(C(C)C/C(=C/C(=O)O)/C)O)/C)/C=C/C1C(C=CC(=O)O1)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:7
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
【Safety informationSymbol】
【Signal word】
【Hazard statements】
【Precautionary statements】
【hazard symbol】
【Risk Code】
【Safe Code】
【UN Code】
1230
【WGK Germany】
1
4CML File
KAZUSAMYCIN A.cml
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