265996-93-8
AZASPIRACID-3
Name
AZASPIRACID-3
Formula
C46 H69 N O12
MolWeight
828.046
1Identification
【Name】
AZASPIRACID-3
【CAS】
【MDL】
MFCD11100320
【English Synonyms】
【Formula】
C46 H69 N O12
【MolWeight】
828.046
【Inchi】
InChI=1S/C46H69NO12/c1-27-21-35-39-36(25-44(56-39)31(5)20-28(2)26-47-44)54-43(23-27,53-35)24-30(4)38-29(3)11-16-45(51,57-38)40(50)41(13-8-7-10-37(48)49)14-9-15-42(58-41)17-18-46(59-42)32(6)22-34-33(55-46)12-19-52-34/h8-9,13,15,27-29,31-36,38-40,47,50-51H,4,7,10-12,14,16-26H2,1-3,5-6H3,(H,48,49)/b13-8+/t27-,28+,29+,31-,32+,33+,34+,35-,36+,38+,39+,40+,41-,42+,43+,44-,45-,46-/m1/s1
【InChIKey】
InChIKey=YMZVXFGCVKFQSX-LDUOPTMTSA-N
【SMILES】
C[C@H]1CC[C@@](O[C@@H]1C(=C)C[C@@]23C[C@@H](C[C@@H](O2)[C@H]4[C@@H](O3)C[C@@]5(O4)[C@@H](C[C@@H](CN5)C)C)C)([C@H]([C@]6(CC=C[C@@]7(O6)CC[C@@]8(O7)[C@H](C[C@H]9[C@@H](O8)CCO9)C)/C=C/CCC(=O)O)O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:4
H bond acceptor:13
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
AZASPIRACID-3.cml
Quick Release
CYCLOBUTANECARBOXAMIDE, 1-AMINO-2-METHYL-, (1R,2S)-
775281-65-7
D-CAMPHOLIC ACID
31147-56-5
2(3H)-FURANONE, DIHYDRO-4,5-DIMETHYL-5-(1-PIPERIDINYLMETHYL)-, CIS-
792849-74-2
SHYOBUNONE
21698-44-2
(+)-CIS-LIMONENE 1,2-EPOXIDE
4680-24-4
3-PIPERIDINEPROPANOIC ACID, 1,3,6-TRIMETHYL-4-OXO-, CIS-
776995-50-7
TOP Suppliers
Porse Fine Chemical Co., Ltd.
Catalog No:PS-PR-2206 nullnull
Country/Region:China
Business Type:Lab/Research institutions
http://www.porsefinechemical.com
Porse Fine Chemical (Shenzhen) Co., Ltd.
Catalog No:PS-PR-2206
Country/Region:China
Business Type:Lab/Research institutions
http://www.porsefinechemical.com
Tractus Company Limited
Catalog No:RT-011353 nullnull
Country/Region:Hong Kong
Business Type:Trading Company
http://www.tractuschem.com
More 265996-93-8 Suppliers>>
Catalog No:PS-PR-2206 nullnull
Country/Region:China
Business Type:Lab/Research institutions
http://www.porsefinechemical.com
Porse Fine Chemical (Shenzhen) Co., Ltd.
Catalog No:PS-PR-2206
Country/Region:China
Business Type:Lab/Research institutions
http://www.porsefinechemical.com
Tractus Company Limited
Catalog No:RT-011353 nullnull
Country/Region:Hong Kong
Business Type:Trading Company
http://www.tractuschem.com
More 265996-93-8 Suppliers>>
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CYCLOBUTANECARBOXAMIDE, 1-AMINO-2-METHYL-, (1R,2S)-
775281-65-7
D-CAMPHOLIC ACID
31147-56-5
2(3H)-FURANONE, DIHYDRO-4,5-DIMETHYL-5-(1-PIPERIDINYLMETHYL)-, CIS-
792849-74-2
SHYOBUNONE
21698-44-2
(+)-CIS-LIMONENE 1,2-EPOXIDE
4680-24-4
3-PIPERIDINEPROPANOIC ACID, 1,3,6-TRIMETHYL-4-OXO-, CIS-
776995-50-7