ID: 19594
SMILES:C=C1COC2c3c(c4c(cc(CCCC)cc4O)OC3(C)CCC1C(C)=C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -14.007
InChIKey:HRIQNHXICKXIQS-UHFFFAOYSA-N
ID: 19595
SMILES:c1(CCCCC)cc(O)c2c(c1O)C1(C)CC=CC(C)(C)OC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.041
InChIKey:GOLHTNHSXCJKOE-UHFFFAOYSA-N
ID: 19596
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(OC(=O)C)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 19597
SMILES:C(C=C(C)C)CC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.619
InChIKey:QQTGMMADPIRSGR-UHFFFAOYSA-N
ID: 19598
SMILES:c1(C)cc2c(c(O)c1C=O)OC1(C)C=CC=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.897
InChIKey:NRIKAMDFLXDKAP-UHFFFAOYSA-N
ID: 19599
SMILES:c1c2c(c(=O)c(C)cc1)OC(C)(C)C1CC=C(C)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.372
CB1 binding score: -15.58
InChIKey:WKZUNUCDGVYVHM-UHFFFAOYSA-N
ID: 19600
SMILES:C(CCC=C(C)CCC=C(C)C)(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 19601
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C(=O)O)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -17.482
InChIKey:LUVSRWROAAHJJR-UHFFFAOYSA-N
ID: 19602
SMILES:c1c(=O)c(C2C=C(C)CCC2C(=C)C)c(O)c(CC=C(C)CCC=C(CCC=C(C)C)C)c(C(OCCc2cc(O)c(O)cc2)=O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 640.861
CB1 binding score: -15.727
InChIKey:AKVYIWNOZXNCEO-UHFFFAOYSA-N
ID: 19603
SMILES:C1C(C)=CCC(C(O)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.591
InChIKey:LWZRRFWEVCBTIX-UHFFFAOYSA-N
ID: 19604
SMILES:C12c3c(cc(CCCCCO)cc3O)OC(C)(C)C1CCC(C)(O)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -16.719
InChIKey:ARQIVUVXCBDACW-UHFFFAOYSA-N
ID: 19605
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 19606
SMILES:C1=C(C)CCC=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.032
InChIKey:NJSZRBFBYZMAGU-UHFFFAOYSA-N
ID: 19607
SMILES:C(C=C(C)C)CC(C)=CCOc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.212
InChIKey:KAUWDDCNXDQADR-UHFFFAOYSA-N
ID: 19608
SMILES:C1CCOC1C12C(O)c3c(cc(CCCCC)cc3O)OC1(C)CCC1C(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.656
InChIKey:APPYZAIRTXXRRF-UHFFFAOYSA-N
ID: 19609
SMILES:C(C)CCCCc1cc2c(o1)-c1c(c(O)c(Cc3c(C)c(CCCCC)ccc3)c(O)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 584.841
CB1 binding score: -12.73
InChIKey:JCXNNBKLWPKOHK-UHFFFAOYSA-N
ID: 19610
SMILES:C1(c2c(O)cc(CCCCC)cc2O)CC(C)CCC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -13.315
InChIKey:KVGRWDPKHDMVAM-UHFFFAOYSA-N
ID: 19611
SMILES:C(C1C(O)C(O)C(O)C(OC(C)CC(O)=O)O1)OC(Cc1c(O)cc2c(c1)OC(C)(C)C1CCC(C)=CC21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 550.601
CB1 binding score: -15.591
InChIKey:FUFONCGQBPQRIN-UHFFFAOYSA-N
ID: 19612
SMILES:C1(C)(C)C2C(c3c(O)cc(CCC)cc3O1)OC(C(C)(C)O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.281
InChIKey:GBKFCRQMFUBDQD-UHFFFAOYSA-N
ID: 19613
SMILES:C12C=C(C)CCC1C(C)(C)Oc1c2cc(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 19614
SMILES:C(O)C1=CC2C(C(C)(C)Oc3c2c(O)cc(CCC)c3)CCC(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.288
InChIKey:MKCJGQSDGDYXEQ-UHFFFAOYSA-N