ID: 93451
SMILES:O=C1C(C(C)=C)C(c2ccc(CCCCCC)cc2)C=C(CO)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.109
InChIKey:UOCCYBLYAFLXQS-UHFFFAOYSA-N
ID: 93452
SMILES:C1C(C)=CC(c2c(CCCCC)cc(O)cc2)OC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -12.484
InChIKey:XITJSBTXIZYFCW-UHFFFAOYSA-N
ID: 93453
SMILES:C(CCC=C(C)C)(C)=CCc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.708
CB1 binding score: -16.918
InChIKey:KZVXUYXJHVIGOT-UHFFFAOYSA-N
ID: 93454
SMILES:c1(OC(=O)C)c2c(c(OC(C)=O)c(C)c1)OC(C)(CCC=C(CCC=C(C)C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -16.728
InChIKey:HHMDVVFVJHVLAT-UHFFFAOYSA-N
ID: 93455
SMILES:O(C(C(C)C)=O)c1cc2c(cc1C)OC1(C(=C)C)CC=C(C)C2CC=C(C)CC2=C1C(=O)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.64
CB1 binding score: -15.293
InChIKey:HEPRIRVQQKORSO-UHFFFAOYSA-N
ID: 93456
SMILES:C(CCO)Cc1cc(OC)c2c(c1)OC(C)(C)C1=C2CC(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -12.147
InChIKey:QOHSRXJXTGNGDZ-UHFFFAOYSA-N
ID: 93457
SMILES:c1(C(N(C)C)CCC(=O)Oc2cc(CCCCC)cc(OC(=O)C)c2OC2CC(C)CCC2C(C)C)ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 565.795
CB1 binding score: Not available
InChIKey:ZDTFFRKSYPZVLN-UHFFFAOYSA-N
ID: 93458
SMILES:C(=CCc1cc(O)c(C)cc1OC(=O)C)(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -19.332
InChIKey:HAXRQCRJABYNJC-UHFFFAOYSA-N
ID: 93459
SMILES:O=Cc1cc2c(cc1)C(C)(C)Oc1c-2cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -16.215
InChIKey:PXHKRQMTOWEZQX-UHFFFAOYSA-N
ID: 93460
SMILES:C1(C)(C)CCCC2(C)C1C(O)Oc1cc(CCCCC)cc(O)c1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.948
InChIKey:NDMZHQJVDQYTBX-UHFFFAOYSA-N
ID: 93461
SMILES:C(CCCC)Cc1cc2c(cc1C)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.524
CB1 binding score: -17.965
InChIKey:OLZZBCBMOAKKLA-UHFFFAOYSA-N
ID: 93462
SMILES:Cc1cc(CC(C)(C)OC)cc2c1CCC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -15.929
InChIKey:HUEWOPQNRRXXDG-UHFFFAOYSA-N
ID: 93463
SMILES:C(C)(C)=CC12C(C)CC(Cc3c(O)cc(CCCCC)cc3O1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.213
InChIKey:XATAMUHSBGDARN-UHFFFAOYSA-N
ID: 93464
SMILES:c1(CCCC)cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 93465
SMILES:C1CC2(c3c(cc(CCCCC)cc3)OC2(C)C)C(c2ccccc2)C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.557
CB1 binding score: -16.352
InChIKey:PKWINUKFHAXHGF-UHFFFAOYSA-N
ID: 93466
SMILES:Oc1c(C(=O)CC(C)C)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.439
InChIKey:MMBSMBBFKYDYEQ-UHFFFAOYSA-N
ID: 93467
SMILES:C(C(CC(=O)c1c(O)c(C2C=C(C)C(O)CC2C(C)=C)ccc1)O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.941
InChIKey:ZVOIZTRLZAXMDV-UHFFFAOYSA-N
ID: 93468
SMILES:C(C=C(C)CCC=C(C)C)c1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 93469
SMILES:C(CCc1cc(O)c2c(c1)C(=O)C1=C3C2(CCC3C)C(C)(C)O1)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -16.791
InChIKey:GHJOYPRKHJLFIW-UHFFFAOYSA-N
ID: 93470
SMILES:CC12C(C)=CCC1C(C)(C)Oc1c(c(O)cc(CCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.318
InChIKey:FEQOVWSOQPGPLW-UHFFFAOYSA-N
ID: 93471
SMILES:c1(CCC(=O)O)cc(O)c(CC=C(C)CCC=C(C)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.143
InChIKey:QEKVOXFOINRURS-UHFFFAOYSA-N