ID: 72367
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 72368
SMILES:C12c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C1CCC(O)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.123
InChIKey:VSZQEUYHLCIKBY-UHFFFAOYSA-N
ID: 72369
SMILES:C(C)(=O)OC1CC=C(C)CC(OC(C)=O)C2C(C(C)(C)Oc3cc(CCCCCO)cc(OC(C)=O)c31)CC=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 570.723
CB1 binding score: -13.563
InChIKey:ZZCWZPFTWFXXEV-UHFFFAOYSA-N
ID: 72370
SMILES:O=C1C(C)COCC2=C3C(OCC34c3c(cc(CCCCC)cc3O)OC4(C(OC)=O)C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.507
CB1 binding score: -15.594
InChIKey:AONOPBZLKUXOKX-UHFFFAOYSA-N
ID: 72371
SMILES:c1(OC)cc(CCCCC)cc2c1OC1(C2=O)C(C)C(C)=CCC1C(=CCC=C(C)CO)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -14.398
InChIKey:MNDXQHFVOWFFBB-UHFFFAOYSA-N
ID: 72372
SMILES:C1(C(=O)O)CCC(C(C)CCC=C(C)C)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.978
InChIKey:LMKUPRSBXPYPMZ-UHFFFAOYSA-N
ID: 72373
SMILES:C1(C)C2(C)C3(c4c(cc(CCC)cc4O)OC2(C)CC1)COC(=O)CC3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: Not available
InChIKey:NYKQHZJPHMMBSQ-UHFFFAOYSA-N
ID: 72374
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 72375
SMILES:c1(O)c2c(cc(C)c1)OCC1(CC=C(CCC=C(C)C)CO1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.157
InChIKey:HCPNDSBVLNQYMR-UHFFFAOYSA-N
ID: 72376
SMILES:C(C)CCCc1cc2c(cc1O)C1C=C(CO)C3C(C1(C)C(C)CC3)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.516
InChIKey:FFIMUFMAGJXLOC-UHFFFAOYSA-N
ID: 72377
SMILES:CC1(C)C2C(c3c(O)cc(CCCCC)cc31)OC(C(O)CCCCC)=C(C)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -13.394
InChIKey:HGMXKTCEUZJOQE-UHFFFAOYSA-N
ID: 72378
SMILES:C1(C)=CCC2C(C1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 72379
SMILES:CC(=C)C1CCC2(C)C3C(C)(CCC21)Oc1c(c(O)cc(CCC)c1)C3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -15.633
InChIKey:GLXGVTGFLFCCPV-UHFFFAOYSA-N
ID: 72380
SMILES:O=c1ccc2c(c(CCCCC)c1)OC(C)(C)C1=C2C(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.285
InChIKey:RZHMYPSFXGDSQY-UHFFFAOYSA-N
ID: 72381
SMILES:c12oc(CCC)cc1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -13.374
InChIKey:NWJBJZYTMHYLAM-UHFFFAOYSA-N
ID: 72382
SMILES:CC(CCC=C(C)C)=CCc1c(OC)c(CC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.853
InChIKey:QSHBEZSOTMYHNS-UHFFFAOYSA-N
ID: 72383
SMILES:C(C1C(C)(C)Oc2cc(CCCCC)cc(OC3C(O)C(O)C(O)C(CO)O3)c21)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.626
CB1 binding score: -16.636
InChIKey:GIYFAFULGSJBMF-UHFFFAOYSA-N
ID: 72384
SMILES:C1(Br)CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2CC1(C)C#CCCC(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 491.466
CB1 binding score: -15.927
InChIKey:FERJZUCFPTXXCP-UHFFFAOYSA-N
ID: 72385
SMILES:CC(=O)C12Oc3c(c4c(c(O)c3)C3C(C(C)(C)O3)CC3C(=O)C5=C(O)C(=O)C(C)=C(C(C=C(C)C)O)C5CC3C(C)(C)O4)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 620.695
CB1 binding score: -14.402
InChIKey:PHBYTQDZNDFYBB-UHFFFAOYSA-N
ID: 72386
SMILES:C(=CCC)CCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.866
InChIKey:VIBWYNNXSMTQAJ-UHFFFAOYSA-N
ID: 72387
SMILES:c1(CCCC)c(O)c2c(cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.082
InChIKey:PBMDVMXHDJRQRK-UHFFFAOYSA-N