ID: 75685
SMILES:CC(C)(C(O)CCC1(C)C23C(c4c(cc(CCCCC)cc4O)O2)CC1CC3)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -13.821
InChIKey:NJMRFHSSUPZETB-UHFFFAOYSA-N
ID: 75686
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C3C(C(C)(O)C21)C=CC(O)(C)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.044
InChIKey:JTXQHFNPDGSYHW-UHFFFAOYSA-N
ID: 75687
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)(C)O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 75688
SMILES:C1=C2C(C)(C)CCCC2(C)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.929
InChIKey:AGYJSWQHVVDKEG-UHFFFAOYSA-N
ID: 75689
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 75690
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCCC)cc2)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.481
InChIKey:YGQOYJUFZSNESF-UHFFFAOYSA-N
ID: 75691
SMILES:C(Cc1cc(O)c2c(c1C)OC(C)(C)C1=CCC(C)(O)CC21)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.765
InChIKey:RLSMJLCWTCKMPN-UHFFFAOYSA-N
ID: 75692
SMILES:c1c(CCCCCC)c(OC)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -11.345
InChIKey:AFZIKMHDAVYJCO-UHFFFAOYSA-N
ID: 75693
SMILES:C12CCC3C(C(=C)CCC1(C)CCC2(C)C)c1c(cc(CCCCC)cc1O)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -15.659
InChIKey:LBCCKSJLVGDZHX-UHFFFAOYSA-N
ID: 75694
SMILES:CC1=CCC(C(=C)C)CC1c1ccc(CCCCC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -16.964
InChIKey:FRHWEKOZROXAID-UHFFFAOYSA-N
ID: 75695
SMILES:c1(O)cc(CCCCC)c(O)c2c1C1(O)CC(=O)C(C)(C)C1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -13.089
InChIKey:ORXZOUZXOOTBLF-UHFFFAOYSA-N
ID: 75696
SMILES:C1C2C(C)(C)CCCC2(C)Oc2cc(CCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 288.431
CB1 binding score: -18.4
InChIKey:IYJFZOBKCYBWAD-UHFFFAOYSA-N
ID: 75697
SMILES:c1(CCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 75698
SMILES:CC(=CCCC(C)=CCc1c(O)cc(CCCCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 75699
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 75700
SMILES:C(CCCCC)c1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(O)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.724
InChIKey:AVNDAFUDDPNHIA-UHFFFAOYSA-N
ID: 75701
SMILES:C1CC(C(=C)C)Oc2c(c(O)cc(CCC)c2)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -12.539
InChIKey:ZUSPWVVEYXKAKS-UHFFFAOYSA-N
ID: 75702
SMILES:c1c(F)cc(C2C(C(=C)C(CC=C(C)C#CC=C(C)C)OC(=O)C)CCC(C)=C2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.568
CB1 binding score: -16.714
InChIKey:DTCRXDHZYQAEFW-UHFFFAOYSA-N
ID: 75703
SMILES:CC1(C)C(CCC(=CCCC2(C)C=Cc3c(ccc(O)c3)O2)C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.509
InChIKey:XTVFMVOKSWJIQO-UHFFFAOYSA-N
ID: 75704
SMILES:O=C(C)Oc1cc(CCCCC)ccc1C1(C)CCC(C)=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.069
InChIKey:BXXRNFHZMRCJDB-UHFFFAOYSA-N
ID: 75705
SMILES:C(C1(C)Oc2c3c(cc(C)c2)OC(C)(C)C2C3CC1(C)CC2)CC(C(O)=O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -16.502
InChIKey:LACFGQQZUWUHFO-UHFFFAOYSA-N