ID: 22618
SMILES:C(=O)C1=CC2C(CC1)C(C)(C)Oc1c2ccc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.345
CB1 binding score: -16.851
InChIKey:FXRKIMRSDZUEOO-UHFFFAOYSA-N
ID: 22619
SMILES:Oc1c2c(cc(OC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.905
InChIKey:RNOQYSXGLMPXLQ-UHFFFAOYSA-N
ID: 22620
SMILES:C12C(C)(OC(C(=CC)C)=O)C(OC(=O)C)C=C1C(C)(C)Oc1c2c(OC(=O)C(C)C)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.562
CB1 binding score: Not available
InChIKey:GRJCZAKHZYZYRJ-UHFFFAOYSA-N
ID: 22621
SMILES:C1(CCC=C(C)CCC=C(C)C)=CCC(c2c(O)cc(C)cc2O)(C(C)C)C(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -14.361
InChIKey:DKUCABALCULMIU-UHFFFAOYSA-N
ID: 22622
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(CCC=C(C)C)(C)O)CCC(C)(C2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -17.68
InChIKey:OQHPXBVDMDMKMP-UHFFFAOYSA-N
ID: 22623
SMILES:C1(Cl)c2c(c(Br)c(C)c(Br)c2)-c2c(cc(CCCCC)cc2O)OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.701
CB1 binding score: -15.265
InChIKey:CYEOUYXNHMAKLU-UHFFFAOYSA-N
ID: 22624
SMILES:C1CC(C)(C(CCC(CC)C)C)Oc2ccc(O)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.42
CB1 binding score: -15.929
InChIKey:YIQFVUDTJXWSTG-UHFFFAOYSA-N
ID: 22625
SMILES:COC(C(C1C2C(c3c(O)cc(CCCCC)cc3OC2(C)C)CC1C)=O)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.078
InChIKey:LIGQFURKVJCTST-UHFFFAOYSA-N
ID: 22626
SMILES:c1(C=O)c(O)c(C(CCC)=O)c2c(c1C1=CC(C)(C)OC1(C)C)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.618
CB1 binding score: -14.951
InChIKey:UCOUOGJSUFVSSH-UHFFFAOYSA-N
ID: 22627
SMILES:C(=O)(C)OCC1=CC2C(CC1)C(C)(C)Oc1c2c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -17.577
InChIKey:AHQPABPKXKUGCW-UHFFFAOYSA-N
ID: 22628
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -18.805
InChIKey:FPNAYBZLIGJJAV-UHFFFAOYSA-N
ID: 22629
SMILES:C12=C(c3c(cc(CCCCC)cc3O)OC1(C)C)C(C)(O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.479
InChIKey:BYSLKERZUKBJHV-UHFFFAOYSA-N
ID: 22630
SMILES:C(c1c(CCCCC)cc2c(c1O)C1CC(C)(O2)CC(C)(C)O1)(=O)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -14.515
InChIKey:OFBRAPZHJQNBGH-UHFFFAOYSA-N
ID: 22631
SMILES:Oc1cc(C)cc(O)c1C1C(C(O)(C)C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.637
InChIKey:CHUDUQRJNYLFSG-UHFFFAOYSA-N
ID: 22632
SMILES:C(C)CCCc1cc(O)c(CC2C(C)(O)CCC3C(C)(C)CCCC32C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.619
CB1 binding score: -16.777
InChIKey:NSLRLRLKYZPEPW-UHFFFAOYSA-N
ID: 22633
SMILES:C(CC(C)=CCc1c(OC)cc(CCCCC)c(C(=O)O)c1O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -19.037
InChIKey:VAFRUJRAAHLCFZ-UHFFFAOYSA-N
ID: 22634
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1=CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.484
InChIKey:SFQCHTBSAMCNBB-UHFFFAOYSA-N
ID: 22635
SMILES:C12(C)Oc3cc(CCCCC)cc(O)c3C3OC(CC=C(C)C)C(C)C4C3C1OC(C(C)(C)C4)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.732
CB1 binding score: -12.764
InChIKey:BHEPATAREAOWTB-UHFFFAOYSA-N
ID: 22636
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 22637
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C2)C(=C)CCC1C(C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.605
InChIKey:ZTYDBSGEBGZPEG-UHFFFAOYSA-N
ID: 22638
SMILES:C1C(C)(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -18.13
InChIKey:BQOIKHJQWFSXOS-UHFFFAOYSA-N