ID: 69385
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(CO)CC21)CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -14.435
InChIKey:OAFKRMQHJMOLIV-UHFFFAOYSA-N
ID: 69386
SMILES:C12C(c3c(cc(CCCCC)c(C(OC)=O)c3O)OC1(C)C)C1C(C)(C3C2(C)C3)C(=O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.618
CB1 binding score: -15.188
InChIKey:MLDAWZIJLKPBOO-UHFFFAOYSA-N
ID: 69387
SMILES:C1C2C(C)(C)Oc3cc(CCc4ccccc4)c(C=O)c(O)c3C2CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -14.901
InChIKey:JGXTYRUKDLRJLI-UHFFFAOYSA-N
ID: 69388
SMILES:C(C)(=C)C1C(c2c(O)cc(CC)cc2O)C=C(C)CCC1C(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.929
InChIKey:HALUTZJVEDZHLE-UHFFFAOYSA-N
ID: 69389
SMILES:C(CCCC)c1cc2c(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: 69390
SMILES:C1(=O)C(CC(CCCCCCCCC)C)=CC2C(CCC(C)=C2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.609
CB1 binding score: -14.041
InChIKey:SBTBRHKHPMEFOX-UHFFFAOYSA-N
ID: 69391
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C(O)=O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.431
InChIKey:AYKYTBMNDZNSMR-UHFFFAOYSA-N
ID: 69392
SMILES:CC1(C)C2CC(=O)C(C)=CC2c2c(O)cc(CCCCCO)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: Not available
InChIKey:UPGVVOQVUZLYOZ-UHFFFAOYSA-N
ID: 69393
SMILES:c1(CCC)c(O)cc2c(c1)OC(C)(C)C1CC=C(CO)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.064
InChIKey:OEGWWCCVYNPUDS-UHFFFAOYSA-N
ID: 69394
SMILES:C(C(OC(=O)C)=C(C)C)CC(C)=CCc1c(O)c2c(cc1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 454.607
CB1 binding score: -14.85
InChIKey:HCTGMRKXIXVIAB-UHFFFAOYSA-N
ID: 69395
SMILES:C1CC=C(C)CCC(=O)C(C)(C)Oc2cc(CCCCC)c(C(OC)=O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -15.954
InChIKey:MJCJQYWQYCEJLH-UHFFFAOYSA-N
ID: 69396
SMILES:C1(O)C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(CCC3C(CO)=CC4OC34C(=C)C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.645
CB1 binding score: -15.079
InChIKey:QQOHVKUBPRDXOY-UHFFFAOYSA-N
ID: 69397
SMILES:C12=C(CCC(=C)C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.847
InChIKey:PBHSKWUIWPWYKU-UHFFFAOYSA-N
ID: 69398
SMILES:C1C=C(C)C(Cc2c(O)c(C(=O)O)c(CCCCC)cc2O)C(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -17.092
InChIKey:KMLDWWAEQGRAKX-UHFFFAOYSA-N
ID: 69399
SMILES:C12C(C)(CC(O)CC(C)=C)C(O)CCC1(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -14.292
InChIKey:DOTPLQOMXBEOKR-UHFFFAOYSA-N
ID: 69400
SMILES:c1(CCCC(C)(C=C)C)ccc2c(c1)OC(C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.416
CB1 binding score: -14.582
InChIKey:CKPAEDMPQPYRQM-UHFFFAOYSA-N
ID: 69401
SMILES:c1(CCC)c(O)c(C2C(C(C)=C)CC(O)C(C)=C2)c(O)c(Br)c1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 395.337
CB1 binding score: -14.141
InChIKey:OXXRASJFNLXZEW-UHFFFAOYSA-N
ID: 69402
SMILES:C(CCCCCCC)Cn1cc2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 343.555
CB1 binding score: -17.561
InChIKey:BPAQEMIVBPRVIS-UHFFFAOYSA-N
ID: 69403
SMILES:c1ccc(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.767
InChIKey:FFUBTKRHDZNPRU-UHFFFAOYSA-N
ID: 69404
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 69405
SMILES:C1C(C(=C)C)C(c2cc(CCNC)ccc2O)C=C(CO)C1N
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.445
CB1 binding score: -15.264
InChIKey:HXEQZPABWQCHHK-UHFFFAOYSA-N