123748-68-5
ESCIN IA
Name
ESCIN IA
Formula
C55 H86 O24
MolWeight
1131.26
1Identification
【Name】
ESCIN IA
【CAS】
【MDL】
MFCD10566608
【English Synonyms】
【Formula】
C55 H86 O24
【MolWeight】
1131.26
【Inchi】
InChI=1S/C55H86O24/c1-10-23(2)46(71)79-43-44(72-24(3)60)55(22-59)26(17-50(43,4)5)25-11-12-30-51(6)15-14-32(52(7,21-58)29(51)13-16-53(30,8)54(25,9)18-31(55)61)75-49-41(77-48-38(67)36(65)34(63)28(20-57)74-48)39(68)40(42(78-49)45(69)70)76-47-37(66)35(64)33(62)27(19-56)73-47/h10-11,26-44,47-49,56-59,61-68H,12-22H2,1-9H3,(H,69,70)/b23-10+/t26-,27+,28+,29+,30+,31+,32-,33+,34+,35-,36-,37+,38+,39-,40-,41+,42-,43-,44-,47-,48-,49+,51-,52+,53+,54+,55-/m0/s1
【InChIKey】
InChIKey=AXNVHPCVMSNXNP-IVKVKCDBSA-N
【SMILES】
C/C=C(\C)/C(=O)O[C@H]1[C@@H]([C@]2([C@@H](CC1(C)C)C3=CC[C@@H]4[C@]5(CC[C@@H]([C@]([C@@H]5CC[C@]4([C@@]3(C[C@H]2O)C)C)(C)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)C)CO)OC(=O)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:13
H bond acceptor:24
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ESCIN IA.cml
Quick Release
TOP Suppliers
Boc Sciences
Catalog No:123748-68-5 up to kgs
Country/Region:United States
Business Type:Trading Company
https://www.bocsci.com/
AvaChem Scientific LLC
Catalog No:2394 100MG
Catalog No:2394 10MG
Country/Region:United States
Business Type:Others
http://www.avachem.com
ChromaDex
Catalog No:ASB-00001477 25MG
Catalog No:ASB-00001477 5MG
Catalog No:ASB-00001477 50MG
Catalog No:ASB-00001477 10MG
Country/Region:United States
Business Type:Others
http://www.chromadex.com
Cerilliant Corporation
Catalog No:PHY80445 1MG
Country/Region:United States
Business Type:Others
http://www.cerilliant.com
BOC Sciences
Catalog No:BAP003680 nullnull
Country/Region:United States
Business Type:Trading Company
http://www.bocsci.com
More 123748-68-5 Suppliers>>
Catalog No:123748-68-5 up to kgs
Country/Region:United States
Business Type:Trading Company
https://www.bocsci.com/
AvaChem Scientific LLC
Catalog No:2394 100MG
Catalog No:2394 10MG
Country/Region:United States
Business Type:Others
http://www.avachem.com
ChromaDex
Catalog No:ASB-00001477 25MG
Catalog No:ASB-00001477 5MG
Catalog No:ASB-00001477 50MG
Catalog No:ASB-00001477 10MG
Country/Region:United States
Business Type:Others
http://www.chromadex.com
Cerilliant Corporation
Catalog No:PHY80445 1MG
Country/Region:United States
Business Type:Others
http://www.cerilliant.com
BOC Sciences
Catalog No:BAP003680 nullnull
Country/Region:United States
Business Type:Trading Company
http://www.bocsci.com
More 123748-68-5 Suppliers>>