ID: 76504
SMILES:c1(C2C(C(C)=C)C(c3c(OC)ccc(CCN(C)C)c3)CC(C)=C2)ccccc1NC(=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.635
CB1 binding score: -17.681
InChIKey:ZARVIOKXEDPQIP-UHFFFAOYSA-N
ID: 76505
SMILES:c1(CCCCC)ccc(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 300.486
CB1 binding score: -19.003
InChIKey:KXYIDYXHLDYCQN-UHFFFAOYSA-N
ID: 76506
SMILES:Oc1cc(CCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 76507
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C=C(C(OC)=O)CCC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.401
InChIKey:MALBUQPNTLLNEE-UHFFFAOYSA-N
ID: 76508
SMILES:C(O)C(C1CC2C(C)(Oc3c(c(O)cc(CCCCC)c3)C2)CC1)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.929
InChIKey:KPYPTSODKIMMBL-UHFFFAOYSA-N
ID: 76509
SMILES:C1C2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 76510
SMILES:C1C2(C)Oc3c(O)c(O)cc(CCCCC)c3C=C2C(C)(C(C(C)C)=O)OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: Not available
InChIKey:ODPDNEVAZVGJMN-UHFFFAOYSA-N
ID: 76511
SMILES:O1C2c3c(O)cc(CCCCC)cc3OC3(C)CC=C2C(C3C(C)C1)C(=O)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -13.181
InChIKey:QVPIMNBKPPMJTR-UHFFFAOYSA-N
ID: 76512
SMILES:C(CCCC)Cc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.458
InChIKey:LZFSGTNLAZDDKK-UHFFFAOYSA-N
ID: 76513
SMILES:C12(C)Oc3c(ccc(CCCCC)c3)C3OC(C(O)(C)CC3)C1C(C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -14.109
InChIKey:WDYQHJLVVXXWQC-UHFFFAOYSA-N
ID: 76514
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)C1)(NCCSCC=C(C)CCC=C(C)C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 515.76
CB1 binding score: -16.502
InChIKey:GTJOUHPFRFMNDG-UHFFFAOYSA-N
ID: 76515
SMILES:OCc1cc(OC)c(OC)c(OC)c1-c1cc2c(cc1)OC(C)(C)C1CCC(C)=CC1C(C(=C)C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.656
CB1 binding score: -15.226
InChIKey:ZSSSQVCNAWJIBG-UHFFFAOYSA-N
ID: 76516
SMILES:C12(Oc3c(c(O)cc(CCC)c3)C1O)C(O)CC(=C)C1CCC=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -13.474
InChIKey:DUYNJFKNXAAPEU-UHFFFAOYSA-N
ID: 76517
SMILES:Oc1c(C2C(C(=C)C)CCC(C)=C2)c(C)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N
ID: 76518
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CC(O)C(C=O)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.956
InChIKey:KZZGLSUGCLMLNA-UHFFFAOYSA-N
ID: 76519
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C(C)(C)O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -17.942
InChIKey:PRKDRANYBPHDBW-UHFFFAOYSA-N
ID: 76520
SMILES:C(CCC)Cc1cc2c(c(O)c1C=O)OC(C)(C)C1C2CC(C)(O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -15.345
InChIKey:KNJLLYNWUDKJJJ-UHFFFAOYSA-N
ID: 76521
SMILES:OC1(C)CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.388
InChIKey:AGVBFQRHTFSUIE-UHFFFAOYSA-N
ID: 76522
SMILES:O1c2cc(CCCC)c(O)c(O)c2C2CC(C)=CCC12C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.12
InChIKey:ZKLBMOPULRNNNV-UHFFFAOYSA-N
ID: 76523
SMILES:Oc1c(Cl)c2c(cc1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 294.778
CB1 binding score: -14.409
InChIKey:MPXJEWRZIZSFJP-UHFFFAOYSA-N
ID: 76524
SMILES:C12C(OC)C3(CC1c1c(O)c(C(=O)O)c(CCCCC)cc1O)OC(C)(C)C1C3CC(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.595
CB1 binding score: -13.393
InChIKey:ZKXJNJAEMXIEGQ-UHFFFAOYSA-N