ID: 123376
SMILES:C1C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 123377
SMILES:CC(C)=CCCc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -16.206
InChIKey:LTBZRKCKKICVIC-UHFFFAOYSA-N
ID: 123378
SMILES:C1(C)=CC2C(CC1O)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 123379
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)CC1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -14.575
InChIKey:XTCMMNSWKQWAIQ-UHFFFAOYSA-N
ID: 123380
SMILES:c12c(c(O)cc(CCC)c1)OC1(C)CCC(C(C)=C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -12.557
InChIKey:RVURDPFDMBHIAC-UHFFFAOYSA-N
ID: 123381
SMILES:C12(O)C(=CCC(C)C1)C(C)(C)Oc1c2c(CCCCC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.964
InChIKey:DWMWRWKESANXSD-UHFFFAOYSA-N
ID: 123382
SMILES:c1(OC)c(O)c2c(cc1CCCC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.422
InChIKey:PTQHQDPMLDIFDB-UHFFFAOYSA-N
ID: 123383
SMILES:CC(C)=CCCC1(C)C=Cc2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 123384
SMILES:c1(CCCCC)cc2c(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: 123385
SMILES:CC(CO)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.483
InChIKey:NOBVLNKOMCEFJL-UHFFFAOYSA-N
ID: 123386
SMILES:C(C1CCC(C)=CC1c1c(O)c(Cc2c(O)c(CC=C(CCC=C(C)C)C)c(O)cc2O)cc(O)c1)(CC=C(C)C)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 574.758
CB1 binding score: -14.095
InChIKey:QLPSMHNEJLIXET-UHFFFAOYSA-N
ID: 123387
SMILES:C(Cc1cc2c(c(O)c1Cl)C1C(C(C)(C)O2)CC=C(C)C1)(=O)NCCc1ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 439.983
CB1 binding score: -15.679
InChIKey:FEAYCXCKYAFKQS-UHFFFAOYSA-N
ID: 123388
SMILES:C(C)(CC(=O)OCC1=CC2c3c(cc(CCCCCC)cc3O)OC(C)(C)C2CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.267
InChIKey:ODYITNFROCFWAX-UHFFFAOYSA-N
ID: 123389
SMILES:c12c(cc(CCCCC)cc1O)cc1c(c2)OC23C(O)(C)CCC(C(C)(C)O2)C13
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -13.653
InChIKey:OOHMVAZTRYUOGF-UHFFFAOYSA-N
ID: 123390
SMILES:CC(C)c1c(O)c(C(C(C)CC)=O)c2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -18.846
InChIKey:CAUAXJSVLHMJOH-UHFFFAOYSA-N
ID: 123391
SMILES:C1(C)(C(=O)O)C2CCC(C)C=C2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.377
InChIKey:OLCPFSUMGCHKMI-UHFFFAOYSA-N
ID: 123392
SMILES:C(CC(C)CCCC(CCC=C(C)C)C)Cc1cc(O)c2c(c1)OC(C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Prenyl quinone meroterpenoids
MW: 416.646
CB1 binding score: -15.358
InChIKey:VEZRGDJCRKGOCA-UHFFFAOYSA-N
ID: 123393
SMILES:C12C(C)=CCC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.334
InChIKey:JRPARYVCKDQCGY-UHFFFAOYSA-N
ID: 123394
SMILES:C1CC(C(C)=C)C(c2cccc(CCCC)c2)C=C(C)C(=O)C(C)=CCC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.6
CB1 binding score: -14.208
InChIKey:ILDXGUHCHDAJAT-UHFFFAOYSA-N
ID: 123395
SMILES:C1C(C(C=CC2C(C)(O)CCC=C(CCC=C(C)C)C)(C)O2)(C)OC(c2cc(CCCCC)cc(O)c2)CC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 552.84
CB1 binding score: -16.998
InChIKey:NIISLLNTNJMSRI-UHFFFAOYSA-N
ID: 123396
SMILES:C1C(=O)C=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(c32)C1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.518
CB1 binding score: -16.202
InChIKey:WNHRMRAMNMXCOJ-UHFFFAOYSA-N