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Heterocyclic compounds

Celogentin C

CAS 370089-23-9Formula C50H70N14O10Molar mass 1,027.20 g/mol
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Celogentin C chemical structure, C50H70N14O10, CAS 370089-23-9
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
370089-23-9
Formula
C50H70N14O10
Molar mass
1,027.20 g/mol
HS code
293379
Category
Heterocyclic compounds

What is Celogentin C?

Plain description, key identifiers and synonyms

Celogentin C has been reported in Celosia argentea.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(7S,10S,13S,19S,22S,25S,28S,29R)-10-[3-(diaminomethylideneamino)propyl]-25-(2-methylpropyl)-9,12,18,21,24,27-hexaoxo-28-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]-22,29-di(propan-2-yl)-2,4,8,11,17,20,23,26,35-nonazahexacyclo[17.16.2.12,5.130,34.013,17.033,36]nonatriaconta-1(36),3,5(39),30(38),31,33-hexaene-7-carboxylic acid
CAS number
370089-23-9 CAS number cross-checked
Molecular formula
C50H70N14O10
InChIKey
ZIUCJBZUJCNMSJ-WYHXJWKRSA-N
InChI
InChI=1S/C50H70N14O10/c1-23(2)17-33-44(68)61-39(25(5)6)46(70)59-34-20-29-28-12-11-26(38(24(3)4)40(47(71)58-33)62-43(67)31-13-14-37(65)55-31)18-32(28)56-41(29)63-21-27(54-22-63)19-35(49(73)74)60-42(66)30(9-7-15-53-50(51)52)57-45(69)36-10-8-16-64(36)48(34)72/h11-12,18,21-25,30-31,33-36,38-40,56H,7-10,13-17,19-20H2,1-6H3,(H,55,65)(H,57,69)(H,58,71)(H,59,70)(H,60,66)(H,61,68)(H,62,67)(H,73,74)(H4,51,52,53)/t30-,31-,33-,34-,35-,36-,38+,39-,40-/m0/s1
Canonical SMILES
CC(C)CC1NC(=O)C(NC(=O)C2CCC(=O)N2)C(C(C)C)c2ccc3c4c([nH]c3c2)-n2cnc(c2)CC(C(=O)O)NC(=O)C(CCCN=C(N)N)NC(=O)C2CCCN2C(=O)C(C4)NC(=O)C(C(C)C)NC1=O
Isomeric SMILES
CC(C)C[C@H]1C(=O)N[C@H](C(=O)N[C@H]2CC3=C(NC4=C3C=CC(=C4)[C@H]([C@@H](C(=O)N1)NC(=O)[C@@H]5CCC(=O)N5)C(C)C)N6C=C(C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]7CCCN7C2=O)CCCN=C(N)N)C(=O)O)N=C6)C(C)C

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
1,027.20 g/molcalc.
Exact mass
1,026.5399 Dacalc.
LogP (octanol/water)
-0.78calc.
Topological polar surface area
359.3 Ųcalc.
Hydrogen bond donors
11calc.
Hydrogen bond acceptors
11calc.
Rotatable bonds
11calc.
Heavy atoms
74calc.
Rings
8calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.58calc.
Formal charge
0calc.
Stereocentres
9calc.
Lipinski rule of five
Fails (3 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C1CNC(=O)C(NC(=O)C2CCC(=O)N2)Cc2ccc3c4c([nH]c3c2)-n2cnc(c2)CCNC(=O)CNC(=O)C2CCCN2C(=O)C(C4)NC(=O)CN1

O=C1CNC(=O)C(NC(=O)C2CCC(=O)N2)Cc2ccc3c4c([nH]c3c2)-n2cnc(c2)CCNC(=O)CNC(=O)C2CCCN2C(=O)C(C4)NC(=O)CN1

8 rings, 54 atoms.

1 other chemical share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Celogentin C suppliers

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Celogentin C price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Celogentin C is traded under.

HS 2933.79Indicative HS code

Lactams, other lactams

World exports in 2024
$16.2B
−64.4% vs 2023, imports $15.4B
2019 to 2024
Top exporters
  1. Ireland37.0%
  2. France * partner reported15.6%
  3. Spain11.3%
Top importers
  1. Germany27.8%
  2. Ireland18.9%
  3. Panama * partner reported12.9%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Celogentin C is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Celogentin C, based on the data on this page

What is Celogentin C?

Celogentin C has been reported in Celosia argentea.

What is the CAS number of Celogentin C?

The CAS registry number of Celogentin C is 370089-23-9.

What is the molecular formula and weight of Celogentin C?

The molecular formula of Celogentin C is C50H70N14O10 and its molar mass is 1,027.20 g/mol.

Is Celogentin C hazardous?

No GHS hazard classification for Celogentin C is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Celogentin C?

Celogentin C is usually classified under HS code 293379 (Lactams, other lactams). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Celogentin C?

Post a free request on CompoundList and suppliers of Celogentin C will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Celogentin C?

Suppliers quote Celogentin C on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Celogentin C

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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