ID: 59389
SMILES:c1(O)cc(C)c(OC)c2c1C(C)(C)C(CCC(O)(C)C)=C(O)c1cc(O)c3c(c12)OC(C)(C)C1C3C=C(C)C(OC(C)=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 606.756
CB1 binding score: -15.922
InChIKey:QOZWRCRRCDOFCR-UHFFFAOYSA-N
ID: 59390
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2C(O)C(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19.298
InChIKey:TZGCTXUTNDNTTE-UHFFFAOYSA-N
ID: 59391
SMILES:CC1=CC2=C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -20.728
InChIKey:RECLSNODOVFMMU-UHFFFAOYSA-N
ID: 59392
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -17.852
InChIKey:SFUFRHMPPGZMCA-UHFFFAOYSA-N
ID: 59393
SMILES:OC1(C)CCC(c2c(O)cc(CCCCC)cc2O)CC(O)(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.526
CB1 binding score: -13.951
InChIKey:OUWMUZCNBZATSP-UHFFFAOYSA-N
ID: 59394
SMILES:CC1=C(CCC(C)=CCc2cc(OCCCC)c(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.696
CB1 binding score: -16.946
InChIKey:PEBLRWFTPFYJJD-UHFFFAOYSA-N
ID: 59395
SMILES:CC1(O)C2Cc3c(O)cc(CCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.438
InChIKey:GLYBIYZKDBVGDK-UHFFFAOYSA-N
ID: 59396
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 59397
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 59398
SMILES:c1(CCCCC)cc(O)c(C2C(C(C)=C)C(C)(C=C)CC2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.123
InChIKey:WPLABPBNOYJVRD-UHFFFAOYSA-N
ID: 59399
SMILES:CC(=C)C1C(c2c(O)cc(CCCC)cc2O)CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.384
InChIKey:UUSBGEURXRLGQE-UHFFFAOYSA-N
ID: 59400
SMILES:C1(C)C2(C)c3c(O)cc(CCC)cc3OC1C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -16.655
InChIKey:UVFFRANZSYPMIX-UHFFFAOYSA-N
ID: 59401
SMILES:OC(=O)c1c(O)c2c(cc1C)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -18.497
InChIKey:AOGTXMDLNOSZCC-UHFFFAOYSA-N
ID: 59402
SMILES:C(CCc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(OC)c1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.255
InChIKey:NHDOHFMGSMMOHI-UHFFFAOYSA-N
ID: 59403
SMILES:C1(C)(O)CCC(C(C)C)C2c3c(O)cc(CCCCC)cc3OC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.961
InChIKey:CNKSTABSFLNANJ-UHFFFAOYSA-N
ID: 59404
SMILES:C=C1CCC(C(=C)C)C(c2c(O)cc(CCC(CC)OC(C)=O)cc2O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.145
InChIKey:NMICXWPLOWLQTN-UHFFFAOYSA-N
ID: 59405
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1OC1C=C(C)CCC1C(C)(O1)C2)CCO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -15.687
InChIKey:GJVSWLLQEPETQA-UHFFFAOYSA-N
ID: 59406
SMILES:CC(C1=CC2C(C)(Oc3c(C(OC)=O)c(CCCCC)cc(O)c32)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -13.732
InChIKey:ZCTDJIHRCWEWLY-UHFFFAOYSA-N
ID: 59407
SMILES:C1C2C(C)=CCC2C(C)(C)Oc2cc(C)c(O)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.251
InChIKey:REHWYTZSXWUMGK-UHFFFAOYSA-N
ID: 59408
SMILES:C(CCCCCC(Cl)(C)C)c1c2c(c(C)cc1O)OC1(C)OCC(C)CC2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 409.01
CB1 binding score: -17.13
InChIKey:UFJRIPXWTQGNPL-UHFFFAOYSA-N
ID: 59409
SMILES:C1(=C)c2c(O)cc(C)cc2OC(C(C=CC=C(CO)C2OC(=O)C(C)=CC2)C)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.51
CB1 binding score: -16.171
InChIKey:KMFBVIVDJAQWDR-UHFFFAOYSA-N