ID: 108634
SMILES:CC1(C)C2c3c(O)c(C(=O)O)c(CCCCC)cc3OC(C)(C2CCC(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.22
InChIKey:AMCKFERKSYYAOG-UHFFFAOYSA-N
ID: 108635
SMILES:c1(O)c(C2CC(C)=CCC2C(C)(C)O)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.969
InChIKey:NPPHBVFNDGBAJA-UHFFFAOYSA-N
ID: 108636
SMILES:CC1C2(c3c(O)cc(CCCCC)cc3OC2=O)C2C(C)(C(=O)CC2C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -15.866
InChIKey:WAUCMJJXMUCCJW-UHFFFAOYSA-N
ID: 108637
SMILES:CC1(C)Oc2cc(CCCCC)cc(OC)c2C2C13CC=C(C)C3CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.059
InChIKey:BKHSOEFIHNPIEF-UHFFFAOYSA-N
ID: 108638
SMILES:C(N=Cc1c(O)c(C2C=C(C)CCC2C(=C)C)c(O)cc1)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.441
CB1 binding score: -17.012
InChIKey:SRBDQPMDPWMQGB-UHFFFAOYSA-N
ID: 108639
SMILES:COc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CC=C(C)CCC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -16.254
InChIKey:IMYKZKILTJCGCO-UHFFFAOYSA-N
ID: 108640
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 108641
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2CC(C)=CCC12C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.519
InChIKey:KTFSZXMNAMQQRJ-UHFFFAOYSA-N
ID: 108642
SMILES:CC1(C)C(=O)C(C=C(C)C)=C(CC(C)=CCc2c(O)cc(CCCCC)cc2O)C=C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -14.927
InChIKey:SVOGHGQZZJRFPQ-UHFFFAOYSA-N
ID: 108643
SMILES:c1(C(=O)c2c(O)c(C3(C)CCC(=O)C3(C)C)cc(O)c2)cc(CCc2cc(O)cc(O)c2)oc1C1C(C(C)=C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 598.736
CB1 binding score: -15.101
InChIKey:KSBQQINPOLVRBI-UHFFFAOYSA-N
ID: 108644
SMILES:C1(C)(C)C2C3(Oc4c(c(O)cc(CCCCC)c4)C1)CCCC3(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -14.28
InChIKey:LJXKBMBXZTZSBY-UHFFFAOYSA-N
ID: 108645
SMILES:C(c1cc(OC)c(C2C=C(C)CCC2C(C)=C)c(O)c1CC=C(CCC=C(C)C)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.745
CB1 binding score: -12.065
InChIKey:MGFRNCMGYQRFDD-UHFFFAOYSA-N
ID: 108646
SMILES:c1(C2C(C(C)(C)O)CC(O)C(CO)=C2)c(O)cc(CCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.735
InChIKey:GDVMXJSQOPMPQN-UHFFFAOYSA-N
ID: 108647
SMILES:c1(OC2(C(C)C)CCC(C)=CC2)ccc(CCCCC)cc1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -13.633
InChIKey:AQNSBICXKUMHTF-UHFFFAOYSA-N
ID: 108648
SMILES:c1(C)c(C2C(C(C)=C)CCC(C)=C2)c(O)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.275
InChIKey:YMYDCZKARLGQSO-UHFFFAOYSA-N
ID: 108649
SMILES:C(C=CCC1(C)C=Cc2c(C)cc(O)cc2O1)(O)(C=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.724
InChIKey:XZPCLRSWRZTZJF-UHFFFAOYSA-N
ID: 108650
SMILES:C1(C(C)CC(=O)CC(C)C)CCC(C)=CC1c1c(O)cc(CCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -15.178
InChIKey:HVVFUQJVWVMTNW-UHFFFAOYSA-N
ID: 108651
SMILES:C(=O)c1c(C2C(C(=NOC(=O)c3ccccc3)C)CC(C)C(C(CC(C)=O)(C)C)=C2)c(O)cc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 489.612
CB1 binding score: -15.44
InChIKey:NIKRTVJBNBZLLM-UHFFFAOYSA-N
ID: 108652
SMILES:CCCCCCc1cc2c(c(O)c1)C1CC(C)=CCC1C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -16.202
InChIKey:UBSXWJDMCABOFT-UHFFFAOYSA-N
ID: 108653
SMILES:C1(C)CCC(C(=C)CO)C(c2c(OC)cc(CCCCC)cc2OC)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -15.929
InChIKey:AMBCVMWGQFKZGQ-UHFFFAOYSA-N
ID: 108654
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -16.43
InChIKey:XKTKRSYUASYBTB-UHFFFAOYSA-N