ID: 101977
SMILES:C(C)(Oc1cc2c(cc1Cl)OC(CCC=C(C)C)(C)C=C2)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.887
CB1 binding score: -15.288
InChIKey:NBSBZKXMBFBPBW-UHFFFAOYSA-N
ID: 101978
SMILES:O1c2c(c(O)cc(CCCCC)c2)C(O)C2(C)C1C1(C)C(C(C)(C)CCC1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.929
InChIKey:AEXMUPWQXXWITA-UHFFFAOYSA-N
ID: 101979
SMILES:CC(=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 101980
SMILES:O(C(=O)C1(O)C(OC(=O)C)C(OC(C)=O)C(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C1C=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 546.657
CB1 binding score: -17.972
InChIKey:NLLQLRWGARHSKX-UHFFFAOYSA-N
ID: 101981
SMILES:C12CCC(C)=CC1c1c(O)cc(CCc3ccccc3)cc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.486
CB1 binding score: -19.258
InChIKey:DYHMKBLKWFFFSZ-UHFFFAOYSA-N
ID: 101982
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: 101983
SMILES:C1(C)=C2Oc3cc(CCCCC)cc(O)c3C2C2C(C(C)C)CCC2(C)C1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.841
InChIKey:HEMYRYKBWCCDSQ-UHFFFAOYSA-N
ID: 101984
SMILES:O1C2C=C(C)CCC2C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.801
InChIKey:NSDOSVJJRXZCDP-UHFFFAOYSA-N
ID: 101985
SMILES:C(c1cc(OC)c(C(C2=CCC(C)CC2)(C)C)cc1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -16.062
InChIKey:VZVBBEGPILBKNX-UHFFFAOYSA-N
ID: 101986
SMILES:C1(C)(C)O-c2cc(O)cc(O)c2C2CC(=C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.099
InChIKey:YYJVPAABBWNLEP-UHFFFAOYSA-N
ID: 101987
SMILES:O=C(c1c2c(c(OC)cc1O)C1CC(C)=CCC1C(C)(C)O2)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -16.015
InChIKey:ALVKOIUTLSJQSS-UHFFFAOYSA-N
ID: 101988
SMILES:c12c(O)cc(CCCCCC)cc1OC1(C)C(C(C)C2)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -13.907
InChIKey:HQSKHEYALINSOR-UHFFFAOYSA-N
ID: 101989
SMILES:CC(C1CC=C(C)C2Oc3c(c(O)cc(CCC)c3)C21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.932
InChIKey:PQWCIIGUTKPXKL-UHFFFAOYSA-N
ID: 101990
SMILES:C(C=C(C)C)CC(C)=CCc1c(O)cc(CCCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.784
InChIKey:QPUHYZGLKQWEKI-UHFFFAOYSA-N
ID: 101991
SMILES:O=C(c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2C=C(C)CC1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -18.257
InChIKey:LSNHDINBKDMRTK-UHFFFAOYSA-N
ID: 101992
SMILES:C(=C(CCC=C(C(O)CC(O)C(O)(C)C)C)C)Cc1c(O)cc(CCc2cc(OC)c(O)cc2)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.659
CB1 binding score: -17.318
InChIKey:XNPIUCFBQWYZHB-UHFFFAOYSA-N
ID: 101993
SMILES:c12cc(O)ccc1OC(C)(C)C1C2CC(CO)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.06
InChIKey:MRZJHEGWWJZQHV-UHFFFAOYSA-N
ID: 101994
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(O)C(C)(O)CCC2=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.351
InChIKey:JIYZRWKZUIXKGI-UHFFFAOYSA-N
ID: 101995
SMILES:c1cc(O)c(C)c2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.214
InChIKey:HYQKKAZWDBDZDD-UHFFFAOYSA-N
ID: 101996
SMILES:C1(c2cc(O)c(C(C)COC(=O)c3ccc(O)cc3)cc2O)C=C(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.521
CB1 binding score: -12.13
InChIKey:WAXJQYVJNHKMAE-UHFFFAOYSA-N
ID: 101997
SMILES:CC1(C)C2CCC(C)=CC2c2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -16.135
InChIKey:SJRMQGGWKWVUAQ-UHFFFAOYSA-N