ID: 83266
SMILES:C(CC1(CC=C(C)C)C(=O)C(O)=C(O)c2c1c(CCCCC)cc(O)c2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -13.661
InChIKey:VTXNKUCMRSTTHQ-UHFFFAOYSA-N
ID: 83267
SMILES:C=C(C1Cc2c(O)cc(CCCCC)c(Oc3ccc4c(c3)CC3C(C)(O4)C4CC(C3)C(C)(C)O4)c2O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.694
CB1 binding score: -15.163
InChIKey:ODKLBSVHGAMGMM-UHFFFAOYSA-N
ID: 83268
SMILES:C1CC(C)=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.389
InChIKey:UHEDSPPIFUFKCL-UHFFFAOYSA-N
ID: 83269
SMILES:CC1CC(=O)C2C(C)(C)CCCC2(C)C12Oc1c(c(O)cc(CCCCC)c1)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -16.412
InChIKey:GPOUNTWAMGNVHJ-UHFFFAOYSA-N
ID: 83270
SMILES:OC(C)(C)C1CCC(C)=CC1c1c(O)cc(CC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -17.241
InChIKey:LDEFFAHGRLWCLP-UHFFFAOYSA-N
ID: 83271
SMILES:C1(C)([N+]#C)C2C(O)CC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.459
CB1 binding score: -18.043
InChIKey:BWRYNGBWASABGC-UHFFFAOYSA-O
ID: 83272
SMILES:C1(C)(C)Oc2c(c(O)cc(C(C(C)CC)=O)c2O)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.012
InChIKey:NSUADMIJIWCJNM-UHFFFAOYSA-N
ID: 83273
SMILES:Oc1cc(CCCC)c2c(c1)OC(C)(C)C1=C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.986
InChIKey:PAOPTJQOJUUNAG-UHFFFAOYSA-N
ID: 83274
SMILES:Oc1c(C)c(Br)cc2c1OC(C)(C)C1CC=C(C)C(C21)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 353.256
CB1 binding score: -13.962
InChIKey:OJENGZYIJZLYTC-UHFFFAOYSA-N
ID: 83275
SMILES:Cc1c(CCC)cc(OC)c2c1OC(C)(C)C1C2CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -11.354
InChIKey:IHBGFLNNZGIYTJ-UHFFFAOYSA-N
ID: 83276
SMILES:O1c2c(cc(CCCCC)cc2O)C2C(C)CCC(=C1C)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.734
InChIKey:CWEZCWILVXRYQM-UHFFFAOYSA-N
ID: 83277
SMILES:COc1c(OC)ccc(C(=O)Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC2C(C)=C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.628
CB1 binding score: -14.639
InChIKey:BYZKPUKYZUDENU-UHFFFAOYSA-N
ID: 83278
SMILES:C(CC=C(C)C)C(=CCc1c(CC)cc(O)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.032
InChIKey:OACOZIDKMOCFIE-UHFFFAOYSA-N
ID: 83279
SMILES:CC(C)C1C=CC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.216
InChIKey:AOOBOQLXJOFYIO-UHFFFAOYSA-N
ID: 83280
SMILES:O=C1C(=O)C2=CC(C)=CC(c3c(O)cc(CCCCC)cc3O2)C2C1(C)CCC2C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -15.374
InChIKey:TUQVRXFSNGPPAW-UHFFFAOYSA-N
ID: 83281
SMILES:c1(CCCC)cc2c(c(O)c1)C1=C(C(C)C)CCC(C)C1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.506
InChIKey:GQKOSPAVVNRABX-UHFFFAOYSA-N
ID: 83282
SMILES:O(c1cc(CCC)c2c(c1O)C=CC(CCC=C(C)C)(C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.323
InChIKey:LHACACBVCSQHSK-UHFFFAOYSA-N
ID: 83283
SMILES:C(O)(=O)C12C(=C(C(C)C)CC1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.324
InChIKey:VJAVRRFBPXSYBH-UHFFFAOYSA-N
ID: 83284
SMILES:CC(=C)C1C2c3ccc(CCCCC)cc3OC2(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.136
InChIKey:ZOCFXCAYGUOHSI-UHFFFAOYSA-N
ID: 83285
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 83286
SMILES:N(=C)C(Cc1cc(C2C=C(C)CCC2C(C)=C)c(O)cc1O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.397
CB1 binding score: -13.356
InChIKey:FWZCZMAKGVZSCB-UHFFFAOYSA-N